SCHEMBL4495320

SCHEMBL4495320

O=C(Nc1ccc(OCCCN2CC3CCCC3C2)cc1)c1ccccc1F

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.55
MET P08581 5/20 0.52
KMT2A Q03164 2/20 0.51
TDP1 Q9NUW8 3/20 0.49
MEN1 O00255 1/20 0.49
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
TP53 P04637 2/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47
MCL1 Q07820 1/20 0.47
POLB P06746 2/20 0.47
LMNA P02545 1/20 0.46
KDM4E B2RXH2 2/20 0.45
EPHX2 P34913 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4495215 0.88 HRH3 (0.55) HRH3METNPC1RAB9AMAPT
SCHEMBL4487999 0.87 HRH3 (0.53) HRH3METEPHX2
Oxalic Acid SCHEMBL5449181 0.84 MEN1 (0.54) HRH3METKMT2AMEN1NPC1
SCHEMBL4492003 0.83 HRH3 (0.64) HRH3KMT2AMEN1MAPTLMNA
SCHEMBL4486970 0.83 HRH3 (0.64) HRH3KMT2AMEN1MAPTLMNA
SCHEMBL4489261 0.83 HRH3 (0.66) HRH3METKMT2AMEN1NPC1
SCHEMBL4489208 0.82 HRH3 (0.51) HRH3METKMT2AMEN1SMN1; SMN2
SCHEMBL4491205 0.81 HRH3 (0.60) HRH3KMT2AMEN1NPC1RAB9A
SCHEMBL4500729 0.80 HRH3 (0.65) HRH3KMT2ATDP1MEN1SMN1; SMN2
SCHEMBL4503943 0.80 POLB (0.55) HRH3KMT2ATDP1MEN1NPC1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7576120-B2 Azabicyclic compounds, a process for their preparation and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2009-08-18 US disclosed
US-20070197625-A1 Azabicyclic compounds, a process for their preparation and pharmaceutical compositions containing them. LES LABORATORATIES SERVIER (FR) 2007-08-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070197625-A1 Azabicyclic compounds, a process for their preparation and pharmaceutical compositions containing them. HRH2, HNMT, HRH1 HRH3 9/4885MET 1844/4885KMT2A 705/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.